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BDBM50172915 (S)-2-(2-Piperidin-1-yl-ethyl)-1,2,3,5,10,10a-hexahydro-imidazo[1,5-b]isoquinoline::CHEMBL383147

SMILES: C(CN1CCCCC1)N1C[C@@H]2Cc3ccccc3CN2C1

InChI Key: InChIKey=RINWTRBQNVRUTN-SFHVURJKSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50172915   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50172915
PNG
((S)-2-(2-Piperidin-1-yl-ethyl)-1,2,3,5,10,10a-hexa...)
Show SMILES C(CN1CCCCC1)N1C[C@@H]2Cc3ccccc3CN2C1
Show InChI InChI=1S/C18H27N3/c1-4-8-19(9-5-1)10-11-20-14-18-12-16-6-2-3-7-17(16)13-21(18)15-20/h2-3,6-7,18H,1,4-5,8-15H2/t18-/m0/s1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 77n/an/an/an/an/an/a



Université de Lille II

Curated by ChEMBL


Assay Description
Inhibitory concentration against opioid receptor sigma 1 of guinea pig cerebral cortex using [3H]-(+)-pentazocine upon incubation for 150 minutes at ...


Bioorg Med Chem Lett 15: 4833-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.040
BindingDB Entry DOI: 10.7270/Q2PN9553
More data for this
Ligand-Target Pair